3-(3,3-dimethyl-2-oxidanylidene-butanoyl)-3-azabicyclo[2.2.1]heptane-2-carboxylic acid

Systemtic Name: 3-(3,3-dimethyl-2-oxidanylidene-butanoyl)-3-azabicyclo[2.2.1]heptane-2-carboxylic acid Openeye Name: 3-(3,3-dimethyl-2-oxo-butanoyl)-3-azabicyclo[2.2.1]heptane-2-carboxylic acid CAS Name: 3-(3,3-dimethyl-1,2-dioxobutyl)-3-azabicyclo[2.2.1]heptane-2-carboxylic acid IUPAC Name: 3-(3,3-dimethyl-2-oxobutanoyl)-3-azabicyclo[2.2.1]heptane-2-carboxylic acid Traditional Name: 3-(2-keto-3,3-dimethyl-butanoyl)-3-azabicyclo[2.2.1]heptane-2-carboxylic acid Formula: C13H19NO4 MolecularWeight: 253.29426

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)(C)C(=O)C(=O)N1C2CCC(C2)C1C(=O)O

Isomeric SMILES

CC(C)(C)C(=O)C(=O)N1C2CCC(C2)C1C(=O)O

InChI

InChI=1S/C13H19NO4/c1-13(2,3)10(15)11(16)14-8-5-4-7(6-8)9(14)12(17)18/h7-9H,4-6H2,1-3H3,(H,17,18)